SCHEMBL3630893

SCHEMBL3630893

CC(C)(C)CN1CCCCC1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 2/20 0.39
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
TSHR P16473 1/20 0.36
ALDH1A1 P00352 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
KDM4E B2RXH2 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
HTR7 P34969 1/20 0.35
LMNA P02545 1/20 0.35
CARM1 Q86X55 1/20 0.35
PRMT6 Q96LA8 1/20 0.35
PRMT8 Q9NR22 1/20 0.35
CHRM5 P08912 1/20 0.35
ADRA2C P18825 1/20 0.35
SIGMAR1 Q99720 1/20 0.34
ATM Q13315 1/20 0.34
PSMB1 P20618 1/20 0.33
PSMB5 P28074 1/20 0.33
PSMB2 P49721 1/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL24891399 1.00 HRH3 (0.39) HRH3MEN1KMT2ATSHRALDH1A1
SCHEMBL135698 1.00 HRH3 (0.39) HRH3MEN1KMT2ATSHRALDH1A1
SCHEMBL22342735 1.00 HRH3 (0.39) HRH3MEN1KMT2ATSHRALDH1A1
SCHEMBL12191564 1.00 HRH3 (0.39) HRH3MEN1KMT2ATSHRALDH1A1
SCHEMBL736306 0.97 LMNA (0.36) HRH3MEN1KMT2ATSHRALDH1A1
SCHEMBL1104718 0.91
SCHEMBL16800195 0.85 TSHR (0.33) TSHRTDP1HTR7ATM
SCHEMBL11840677 0.84
SCHEMBL19543019 0.84 HTR7 (0.34) HTR7
SCHEMBL12092353 0.84 HTR7 (0.34) HTR7

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2146967-A2 TETRAHYDROINDOLE AND TETRAHYDROINDAZOLE DERIVATIVES Serenex, Inc. (US) 2010-01-27 EP disclosed
WO-2008130879-A2 TETRAHYDROINDOLE AND TETRAHYDROINDAZOLE DERIVATIVES SERENEX, INC. (US) 2008-10-30 WO disclosed
US-20080269193-A1 Tetrahydroindole and Tetrahydroindazole Derivatives SERENEX, INC. 2008-10-30 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080269193-A1 Tetrahydroindole and Tetrahydroindazole Derivatives HSF1, HSP90AB1, TPH1 HRH3 618/4885MEN1 3885/4885KMT2A 4294/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.